Geometry & MOs

Info

ID:	345525
PubChem CID:	127269825
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-83.03
Dipole, Da:	6.9
IP(EA), eV:	-8.7(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[[4-(4-methylpiperazine-1-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC2=CC=CC=C2CNC(=O)NC3CCCNC3=O

DOS

IR

Vibrations