Geometry & MOs

Info

ID:	367244
PubChem CID:	127324021
Reduced:	O2N4C15H26 (1)
Stoich.:	A2B4C15D26 (1)
Weight, g/mol:	377.096476
ΔH_f, kcal/mol:	-86.15
Dipole, Da:	5.0
IP(EA), eV:	-8.8(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5-chlorothiophen-2-yl)ethyl]-5-oxo-7-phenyl-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CNC(=O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations