Geometry & MOs

Info

ID:	225116
PubChem CID:	85741801
Reduced:	NSiO3C21H43 (1)
Stoich.:	ABC3D21E43 (1)
Weight, g/mol:	264.102941
ΔH_f, kcal/mol:	-259.16
Dipole, Da:	2.1
IP(EA), eV:	-8.84(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-phenyl-2,3,4a,5,6,7,8,8a-octahydro-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

CCCCN1C(=O)CCC1(CCCCO[Si](C(C)C)(C(C)C)C(C)C)O

DOS

IR

Vibrations