Geometry & MOs

Info

ID:	358150
PubChem CID:	127295695
Reduced:	N3O3C22H33 (1)
Stoich.:	A3B3C22D33 (1)
Weight, g/mol:	364.247441
ΔH_f, kcal/mol:	-123.63
Dipole, Da:	4.84
IP(EA), eV:	-8.65(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-cyclopentylacetyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)-1,4-diazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)N3CCC(C3)N4CCCCC4

DOS

IR

Vibrations