Geometry & MOs

Info

ID:	216814
PubChem CID:	85086819
Reduced:	SiO2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	304.01856
ΔH_f, kcal/mol:	-126.32
Dipole, Da:	1.69
IP(EA), eV:	-8.55(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-chloro-5-pyridin-4-ylsulfanyl-6H-quinazolin-4-one

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(OCC=C)OCC=CC1=CC=CC=C1

DOS

IR

Vibrations