Geometry & MOs

Info

ID:	89443
PubChem CID:	49961799
Reduced:	N2O2H22C23 (1)
Stoich.:	A2B2C22D23 (1)
Weight, g/mol:	315.121906
ΔH_f, kcal/mol:	-29.01
Dipole, Da:	3.37
IP(EA), eV:	-8.62(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-4H-pyran-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C2C3=C(C=CC4=CC=CC=C43)OC(=C2C(=O)N)N)C

DOS

IR

Vibrations