Geometry & MOs

Info

ID:	324030
PubChem CID:	126676786
Reduced:	N8H14C17 (1)
Stoich.:	A8B14C17 (1)
Weight, g/mol:	659.04351
ΔH_f, kcal/mol:	189.32
Dipole, Da:	5.63
IP(EA), eV:	-9.08(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2S)-2-[[[(3R,4R)-4-bromo-4-chloro-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-naphthalen-1-yloxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C=C(C=N2)CC3=CC(=NC4=NNN=C34)N)C#N

DOS

IR

Vibrations