Geometry & MOs

Info

ID:	89469
PubChem CID:	49961991
Reduced:	N3O3C17H17 (1)
Stoich.:	A3B3C17D17 (1)
Weight, g/mol:	287.072848
ΔH_f, kcal/mol:	-61.52
Dipole, Da:	5.92
IP(EA), eV:	-8.46(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7-diamino-4-thiophen-2-yl-4H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2C3=C(C=C(C=C3)N)OC(=C2C(=O)N)N

DOS

IR

Vibrations