Geometry & MOs

Info

ID:	89499
PubChem CID:	49962111
Reduced:	OSN3H13C15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	305.152812
ΔH_f, kcal/mol:	42.37
Dipole, Da:	5.92
IP(EA), eV:	-8.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,7-diamino-4-(2,4,6-trimethylphenyl)-4H-chromene-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2C3=C(C=C(C=C3)N)OC(=C2C#N)N

DOS

IR

Vibrations