Geometry & MOs

Info

ID:	416309
PubChem CID:	135089322
Reduced:	ON4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	332.221226
ΔH_f, kcal/mol:	10.67
Dipole, Da:	3.9
IP(EA), eV:	-9.04(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[(3S,4R)-3-hydroxy-4-(pyrazin-2-ylmethyl)pyrrolidin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CCC(C1=CN(N=C1)C)NC(=O)C2=CC=CN2C

DOS

IR

Vibrations