Geometry & MOs

Info

ID:	276364
PubChem CID:	103822496
Reduced:	ON3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	314.126657
ΔH_f, kcal/mol:	23.26
Dipole, Da:	3.37
IP(EA), eV:	-10.01(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(phenylmethoxycarbonyl)amino]-2-(4-methylpyridin-3-yl)acetic acid

Drug info:

PubChemData

Smile

CC[C@@H](C1=NC(=NO1)CC2CC2)N

DOS

IR

Vibrations