Geometry & MOs

Info

ID:	342995
PubChem CID:	127266158
Reduced:	N2O5C17H26 (1)
Stoich.:	A2B5C17D26 (1)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-198.07
Dipole, Da:	2.87
IP(EA), eV:	-9.56(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-N-[5-(methoxymethyl)-1,3-thiazol-2-yl]-1-methyl-2-phenylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCCCC1)CNC(=O)COCC2=C(N=CO2)C(=O)OC

DOS

IR

Vibrations