Geometry & MOs

Info

ID:	324258
PubChem CID:	126677250
Reduced:	N3O3C10H17 (1)
Stoich.:	A3B3C10D17 (1)
Weight, g/mol:	547.148644
ΔH_f, kcal/mol:	-81.08
Dipole, Da:	0.8
IP(EA), eV:	-8.81(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[[3-chloro-2-[1-(2,4-dioxopyrimidin-1-yl)ethoxy]propoxy]-phenoxyphosphoryl]amino]-3-methoxy-2-methylpropanoate

Drug info:

PubChemData

Smile

C1COCC(COCCN1C2=CC=NN2)O

DOS

IR

Vibrations