Geometry & MOs

Info

ID:	205546
PubChem CID:	80119465
Reduced:	N2O4C15H26 (1)
Stoich.:	A2B4C15D26 (1)
Weight, g/mol:	301.200156
ΔH_f, kcal/mol:	-221.94
Dipole, Da:	5.03
IP(EA), eV:	-9.75(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[2-(carbamoylamino)-3-methylpentanoyl]amino]methyl]-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1CCCN(C1)C(=O)C)C(=O)O

DOS

IR

Vibrations