Geometry & MOs

Info

ID:	410435
PubChem CID:	135083231
Reduced:	NPO4C5H8 (1)
Stoich.:	ABC4D5E8 (1)
Weight, g/mol:	186.034685
ΔH_f, kcal/mol:	-141.89
Dipole, Da:	6.19
IP(EA), eV:	-9.31(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1,3]azaphospholo[2,1-a]phthalazine

Drug info:

PubChemData

Smile

CC1(CCC=[N+]1[O-])P(=O)([O-])[O-]

DOS

IR

Vibrations