Geometry & MOs

Info

ID:	213016
PubChem CID:	81062504
Reduced:	ClOSN2C12H21 (1)
Stoich.:	ABCD2E12F21 (1)
Weight, g/mol:	274.189257
ΔH_f, kcal/mol:	-43.39
Dipole, Da:	3.31
IP(EA), eV:	-9.17(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-methyl-2-[[methyl(2-propan-2-yloxyethyl)carbamoyl]amino]pentanoic acid

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(C)C1=NC(=CS1)CCl

DOS

IR

Vibrations