Geometry & MOs

Info

ID:	323868
PubChem CID:	126676380
Reduced:	FN3O3C19H20 (1)
Stoich.:	AB3C3D19E20 (1)
Weight, g/mol:	369.132471
ΔH_f, kcal/mol:	-122.91
Dipole, Da:	1.4
IP(EA), eV:	-9.54(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[5-(cyclopropylcarbamoyl)-3-(methylcarbamoyl)-2-oxopyridin-1-yl]methyl]benzoic acid

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]1NC(=O)C2=CN(C(=O)C(=C2)C(=O)NC)CC3=CC(=CC=C3)F

DOS

IR

Vibrations