Geometry & MOs

Info

ID:	89468
PubChem CID:	49961989
Reduced:	N3O3C18H19 (1)
Stoich.:	A3B3C18D19 (1)
Weight, g/mol:	311.126991
ΔH_f, kcal/mol:	-79.97
Dipole, Da:	4.9
IP(EA), eV:	-8.53(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C2C3=C(C=C(C=C3)N)OC(=C2C(=O)N)N

DOS

IR

Vibrations