Geometry & MOs

Info

ID:	138668
PubChem CID:	52404214
Reduced:	ON2C21H34 (1)
Stoich.:	AB2C21D34 (1)
Weight, g/mol:	352.189926
ΔH_f, kcal/mol:	-69.22
Dipole, Da:	4.88
IP(EA), eV:	-8.53(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[(3R,5S)-3,5-dimethylpiperidine-1-carbonyl]-2-methylphenyl]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC[C@@H](C)N(CC1=CC=C(C=C1)C)C(=O)CCC2CCN(CC2)C

DOS

IR

Vibrations