Geometry & MOs

Info

ID:	15354
PubChem CID:	438615
Reduced:	N2P2C6O7H14 (1)
Stoich.:	A2B2C6D7E14 (1)
Weight, g/mol:	288.027625
ΔH_f, kcal/mol:	-384.06
Dipole, Da:	4.97
IP(EA), eV:	-9.98(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-nitroso-2-phosphonoazepan-2-yl)phosphonic acid

Drug info:

PubChemData

Smile

C1CCC(N(CC1)N=O)(P(=O)(O)O)P(=O)(O)O

DOS

IR

Vibrations