Geometry & MOs

Info

ID:	150275
PubChem CID:	53789963
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	532.224119
ΔH_f, kcal/mol:	-126.82
Dipole, Da:	3.48
IP(EA), eV:	-8.87(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[3-(N-carbamoyl-3-methylanilino)-5-(3-chlorophenyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1OCC(CNC(C)C)O)C(=O)N

DOS

IR

Vibrations