Geometry & MOs

Info

ID:	347283
PubChem CID:	127272077
Reduced:	SN2O3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	385.272927
ΔH_f, kcal/mol:	-101.73
Dipole, Da:	5.14
IP(EA), eV:	-8.06(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-1-propanoylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=C(S2)C(=O)NCC(=O)NC3=CC4=C(C=C3)OCCC4

DOS

IR

Vibrations