Geometry & MOs

Info

ID:	218323
PubChem CID:	85089171
Reduced:	O5C11H12 (2)
Stoich.:	A5B11C12 (2)
Weight, g/mol:	448.163436
ΔH_f, kcal/mol:	-406.3
Dipole, Da:	3.34
IP(EA), eV:	-9.47(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-ethenyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyridin-4-yl] N,N-diphenylcarbamate

Drug info:

PubChemData

Smile

CC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=CC=C(C=C3)O)C4C(C(C(C(O4)CO)O)O)O)O

DOS

IR

Vibrations