Geometry & MOs

Info

ID:	344491
PubChem CID:	127268075
Reduced:	FO2N3C21H30 (1)
Stoich.:	AB2C3D21E30 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-146.54
Dipole, Da:	4.1
IP(EA), eV:	-9.21(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyanophenyl)piperazin-1-yl]-N-cyclopropyl-N-(1-cyclopropylethyl)acetamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations