Geometry & MOs

Info

ID:	132061
PubChem CID:	51300962
Reduced:	SO2N4C20H30 (1)
Stoich.:	AB2C4D20E30 (1)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	-53.73
Dipole, Da:	3.2
IP(EA), eV:	-8.68(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[4-[1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)N2CCN(CC2)C(C)C(=O)NC3=CC=CC=C3SC

DOS

IR

Vibrations