Geometry & MOs

Info

ID:	175303
PubChem CID:	75880912
Reduced:	N3O3C28H39 (1)
Stoich.:	A3B3C28D39 (1)
Weight, g/mol:	354.176585
ΔH_f, kcal/mol:	-138.5
Dipole, Da:	3.58
IP(EA), eV:	-8.37(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-thiophen-3-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1CCCCN1CC2=CC=CC=C2CNC(=O)C(CC(C)C)N3C(=O)C4CC=CCC4C3=O

DOS

IR

Vibrations