Geometry & MOs

Info

ID:	170152
PubChem CID:	75205078
Reduced:	SO2N3H21C23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	388.215078
ΔH_f, kcal/mol:	30.97
Dipole, Da:	3.51
IP(EA), eV:	-8.62(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(4-benzylpiperidin-1-yl)-3-oxoprop-1-enyl]-N-cyclopropylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C=CC3=CC=C(C=C3)C(=O)NC4CC4

DOS

IR

Vibrations