Geometry & MOs

Info

ID:	143384
PubChem CID:	53200437
Reduced:	N3O5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-143.63
Dipole, Da:	4.54
IP(EA), eV:	-9.08(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-6,11-dioxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)-N-(1-pyridin-2-ylethyl)acetamide

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1C3=CC(=CC(=C3)OC)OC

DOS

IR

Vibrations