Geometry & MOs

Info

ID:	251360
PubChem CID:	103103410
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	299.184506
ΔH_f, kcal/mol:	-163.41
Dipole, Da:	6.19
IP(EA), eV:	-9.62(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]methyl]cyclohexyl]acetic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NC(CC(=O)O)C1=CC=CC=C1

DOS

IR

Vibrations