Geometry & MOs

Info

ID:

82344

PubChem CID:

49855916

Reduced:

SO3N4H28C33 (1)

Stoich.:

AB3C4D28E33 (1)

Weight, g/mol:

527.133734

ΔHf, kcal/mol:

14.76

Dipole, Da:

2.0

IP(EA), eV:

 -8.82(-1.06)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-cyclopropyl-6-[4-[(3-methylthiophene-2-carbonyl)amino]benzoyl]-4,5-dihydrothieno[3,2-d][1]benzazepine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC2=C1C(=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)N4CCC5=C(C6=CC=CC=C64)SC(=C5)C(=O)NC7CC7

DOS

IR

Vibrations