Geometry & MOs

Info

ID:	68039
PubChem CID:	46507644
Reduced:	BrN2O4H15C18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	374.066949
ΔH_f, kcal/mol:	-106.3
Dipole, Da:	4.82
IP(EA), eV:	-8.9(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methoxyphenyl)-5-(hydroxymethyl)-8-methyl-2-oxopyrano[2,3-c]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C(=NC=C3CO)C)OC2=O)Br

DOS

IR

Vibrations