Geometry & MOs

Info

ID:	369424
PubChem CID:	127333361
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	261.184112
ΔH_f, kcal/mol:	-18.58
Dipole, Da:	4.89
IP(EA), eV:	-8.49(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethylphenyl)-2,4-dimethylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)N2CCC3=CC=CC=C32)C

DOS

IR

Vibrations