Geometry & MOs

Info

ID:	14616
PubChem CID:	416150
Reduced:	NO4C9H17 (1)
Stoich.:	AB4C9D17 (1)
Weight, g/mol:	203.115758
ΔH_f, kcal/mol:	-204.75
Dipole, Da:	5.68
IP(EA), eV:	-10.5(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethoxycarbonylamino)-3-methylpentanoic acid

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)O)NC(=O)OCC

DOS

IR

Vibrations