Geometry & MOs

Info

ID:	155786
PubChem CID:	56367547
Reduced:	FO2N4C26H29 (1)
Stoich.:	AB2C4D26E29 (1)
Weight, g/mol:	360.204907
ΔH_f, kcal/mol:	-72.31
Dipole, Da:	0.71
IP(EA), eV:	-8.91(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]piperidin-3-yl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)C(=O)C2=CN(N=C2C3=CC=C(C=C3)C)C4=CC=C(C=C4)F

DOS

IR

Vibrations