Geometry & MOs

Info

ID:	89477
PubChem CID:	49962048
Reduced:	N2O4C17H18 (1)
Stoich.:	A2B4C17D18 (1)
Weight, g/mol:	341.137556
ΔH_f, kcal/mol:	-122.66
Dipole, Da:	3.24
IP(EA), eV:	-8.56(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7-diamino-4-(3,4-dimethoxyphenyl)-4H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(O3)C)C=CC(=C2)N)N

DOS

IR

Vibrations