Geometry & MOs

Info

ID:	358533
PubChem CID:	127296129
Reduced:	N3O3C16H31 (1)
Stoich.:	A3B3C16D31 (1)
Weight, g/mol:	364.283826
ΔH_f, kcal/mol:	-156.58
Dipole, Da:	4.03
IP(EA), eV:	-8.97(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-cyclopentylacetyl)amino]ethyl]-3-pyrrolidin-1-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)N(C)CC2CCCOC2)C

DOS

IR

Vibrations