Geometry & MOs

Info

ID:	159301
PubChem CID:	57269519
Reduced:	ON3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	74.42
Dipole, Da:	0.65
IP(EA), eV:	-8.31(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylbutylamino) 5-amino-3-methylpentanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C#CN2C=NC3=C(C2O)C=CN3

DOS

IR

Vibrations