Geometry & MOs

Info

ID:	144827
PubChem CID:	53420312
Reduced:	NOC4H5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	267.12356
ΔH_f, kcal/mol:	-62.78
Dipole, Da:	2.56
IP(EA), eV:	-9.02(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azaniumyl-6-diethoxyphosphorylhexanoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)N)C(=O)OC

DOS

IR

Vibrations