Geometry & MOs

Info

ID:	57531
PubChem CID:	22405465
Reduced:	F3N4O7C24H29 (1)
Stoich.:	A3B4C7D24E29 (1)
Weight, g/mol:	307.105587
ΔH_f, kcal/mol:	-429.67
Dipole, Da:	5.5
IP(EA), eV:	-9.07(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(2,2-dimethoxyethyl)-6-(furan-2-yl)-2-oxopyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)C(F)(F)F)NC(=O)CN1C(=CC=C(C1=O)NC(=O)NC(CO)(CO)CO)C2=CC=CC=C2

DOS

IR

Vibrations