Geometry & MOs

Info

ID:	281690
PubChem CID:	103914223
Reduced:	ON2C5H9 (2)
Stoich.:	AB2C5D9 (2)
Weight, g/mol:	230.163043
ΔH_f, kcal/mol:	-78.2
Dipole, Da:	2.76
IP(EA), eV:	-9.46(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]acetate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(=O)NCCC#N

DOS

IR

Vibrations