Geometry & MOs

Info

ID:	148832
PubChem CID:	53788501
Reduced:	FN2O6C32H35 (1)
Stoich.:	AB2C6D32E35 (1)
Weight, g/mol:	237.07661
ΔH_f, kcal/mol:	-235.08
Dipole, Da:	7.11
IP(EA), eV:	-8.9(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-dimethoxyphosphoryl-3-(dimethylamino)prop-2-enoate

Drug info:

PubChemData

Smile

CCC1=CC(=CC(=C1NC(=O)CN2C[C@@H](C([C@@H]2C3=CC=C(C=C3)OCC)C(=O)O)C4=CC5=C(C=C4)OCO5)CC)F

DOS

IR

Vibrations