Geometry & MOs

Info

ID:	367350
PubChem CID:	127324302
Reduced:	ClO2N4C18H23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	363.194677
ΔH_f, kcal/mol:	-51.13
Dipole, Da:	1.62
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-1-ylmethyl)-5-oxo-7-phenyl-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)NC3CCN(C3=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations