Geometry & MOs

Info

ID:	152274
PubChem CID:	56311170
Reduced:	O3N5C25H35 (1)
Stoich.:	A3B5C25D35 (1)
Weight, g/mol:	396.204907
ΔH_f, kcal/mol:	-107.53
Dipole, Da:	3.35
IP(EA), eV:	-8.67(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-[4-[(4-methoxyphenyl)methyl]piperidin-1-yl]acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CN3CCC(CC3)CC4=CC=C(C=C4)OC)CC

DOS

IR

Vibrations