Geometry & MOs

Info

ID:	177047
PubChem CID:	76130277
Reduced:	O3C9H11 (2)
Stoich.:	A3B9C11 (2)
Weight, g/mol:	385.200156
ΔH_f, kcal/mol:	-257.9
Dipole, Da:	8.26
IP(EA), eV:	-9.99(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 6-amino-2-[amino(phenylmethoxycarbonyl)amino]hexanoate

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2CCC3C(C2C1)C(=O)C(=CO3)C=CC(=O)O

DOS

IR

Vibrations