Geometry & MOs

Info

ID:	147008
PubChem CID:	53777027
Reduced:	N2O2C9H16 (2)
Stoich.:	A2B2C9D16 (2)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-205.24
Dipole, Da:	3.14
IP(EA), eV:	-9.26(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2S)-2,5-diamino-2-(methylcarbamoyl)pentanoate

Drug info:

PubChemData

Smile

CCCCCCCCC1(C(=O)NC(=O)NC1=O)C2CNCCN2CCO

DOS

IR

Vibrations