Geometry & MOs

Info

ID:	233043
PubChem CID:	87691722
Reduced:	PN3O4C18H45 (1)
Stoich.:	AB3C4D18E45 (1)
Weight, g/mol:	196.07387
ΔH_f, kcal/mol:	-204.03
Dipole, Da:	5.32
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.757781
Charge, e:	-1

Chem-info

IUPAC name:

3-(trimethylazaniumyl)propyl phosphate

Drug info:

PubChemData

Smile

CCC([N+](C)(C)C)OP(=O)(OC(CC)[N+](C)(C)C)OC(CC)[N+](C)(C)C

DOS

IR

Vibrations