Geometry & MOs

Info

ID:	161830
PubChem CID:	57392801
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	611.201889
ΔH_f, kcal/mol:	-147.64
Dipole, Da:	3.01
IP(EA), eV:	-9.6(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3,5-bis(trifluoromethyl)phenyl]-N-[4-(4-fluoro-2-methylphenyl)-6-[4-(hydroxymethyl)-5-oxopyrrolidin-3-yl]pyridin-3-yl]-N,2-dimethylpropanamide

Drug info:

PubChemData

Smile

CCCCN(C)C(=O)C1CCOC1=O

DOS

IR

Vibrations