Geometry & MOs

Info

ID:	152485
PubChem CID:	56311422
Reduced:	F2N2O2C23H28 (1)
Stoich.:	A2B2C2D23E28 (1)
Weight, g/mol:	377.210327
ΔH_f, kcal/mol:	-150.52
Dipole, Da:	6.36
IP(EA), eV:	-8.68(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanophenyl)-3-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]propanamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC2CCN(CC2)CC(=O)NCCC3=C(C=CC=C3F)F

DOS

IR

Vibrations