Geometry & MOs

Info

ID:	147165
PubChem CID:	53786818
Reduced:	NSO4C23H29 (1)
Stoich.:	ABC4D23E29 (1)
Weight, g/mol:	216.031648
ΔH_f, kcal/mol:	-123.64
Dipole, Da:	4.86
IP(EA), eV:	-8.6(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[ethoxy(methyl)phosphoryl]ethylphosphonic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2CC3=C(C=C(C=C3)OC)C(C2(C)C)(C=C)O

DOS

IR

Vibrations