Geometry & MOs

Info

ID:	149301
PubChem CID:	53788973
Reduced:	OC13H20 (1)
Stoich.:	AB13C20 (1)
Weight, g/mol:	275.105862
ΔH_f, kcal/mol:	-63.96
Dipole, Da:	3.84
IP(EA), eV:	-9.76(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methylpyridin-3-yl)-5H-chromeno[4,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC1CC(=O)C2C1(C3C2CCCC3)C

DOS

IR

Vibrations