Geometry & MOs

Info

ID:	312188
PubChem CID:	126603509
Reduced:	NO4C9H17 (1)
Stoich.:	AB4C9D17 (1)
Weight, g/mol:	385.167142
ΔH_f, kcal/mol:	-198.34
Dipole, Da:	3.64
IP(EA), eV:	-10.01(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]-4-(2-methylpropoxy)-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CC(C)COC(=O)C[C@@H](C(=O)OC)N

DOS

IR

Vibrations