Geometry & MOs

Info

ID:	152035
PubChem CID:	56310884
Reduced:	O2N5C23H31 (1)
Stoich.:	A2B5C23D31 (1)
Weight, g/mol:	434.268176
ΔH_f, kcal/mol:	-36.99
Dipole, Da:	3.97
IP(EA), eV:	-8.87(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]-N-(2-methyl-4-pyrrolidin-1-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N2CCN(CC2)CC(=O)NC3=CC=NN3C4CCCC4

DOS

IR

Vibrations