Geometry & MOs

Info

ID:	357918
PubChem CID:	127295418
Reduced:	ClO2N3C20H28 (1)
Stoich.:	AB2C3D20E28 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-92.95
Dipole, Da:	3.39
IP(EA), eV:	-8.99(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyclopentylacetyl)-1,4-diazepan-1-yl]-N-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations