Geometry & MOs

Info

ID:	351930
PubChem CID:	127282848
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	322.236876
ΔH_f, kcal/mol:	-120.76
Dipole, Da:	2.77
IP(EA), eV:	-8.85(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(cyclopentylamino)-1-oxopropan-2-yl]-N-(cyclopropylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)OCO2)NC(=O)N3CCN(CC3)C(C)C(=O)NC4CC4

DOS

IR

Vibrations