Geometry & MOs

Info

ID:	197547
PubChem CID:	78976436
Reduced:	SN3O3C11H17 (1)
Stoich.:	AB3C3D11E17 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-114.82
Dipole, Da:	6.33
IP(EA), eV:	-9.9(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoic acid

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)O)NC(=O)NCC1=NC=CS1

DOS

IR

Vibrations