Geometry & MOs

Info

ID:	130519
PubChem CID:	51091033
Reduced:	O4N5C15H19 (1)
Stoich.:	A4B5C15D19 (1)
Weight, g/mol:	331.225977
ΔH_f, kcal/mol:	-102.12
Dipole, Da:	4.61
IP(EA), eV:	-8.8(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-[4-(3-methoxyphenyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)NC(=O)CNC2=NN(C=C2)CC(=O)N)OC

DOS

IR

Vibrations