Geometry & MOs

Info

ID:	302923
PubChem CID:	124403684
Reduced:	N2O2C21H34 (1)
Stoich.:	A2B2C21D34 (1)
Weight, g/mol:	364.251464
ΔH_f, kcal/mol:	-107.61
Dipole, Da:	3.86
IP(EA), eV:	-8.55(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-4-[[(3S)-3-methylpiperidin-1-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC[C@@H](C(=O)NCCCN1C[C@H](C[C@@H](C1)C)C)OC2=CC=CC=C2C

DOS

IR

Vibrations