Geometry & MOs

Info

ID:	363629
PubChem CID:	127311730
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	380.188212
ΔH_f, kcal/mol:	-56.13
Dipole, Da:	2.72
IP(EA), eV:	-9.06(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]ethyl]-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)NCCN(C)C3CC3

DOS

IR

Vibrations