Geometry & MOs

Info

ID:	381942
PubChem CID:	134972808
Reduced:	SiN2O7C40H48 (1)
Stoich.:	AB2C7D40E48 (1)
Weight, g/mol:	332.073471
ΔH_f, kcal/mol:	-198.51
Dipole, Da:	5.92
IP(EA), eV:	-8.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[2-(3,4-dichlorophenyl)phenyl]methanone

Drug info:

PubChemData

Smile

CC1=C(C=C(C2=C1OCO2)[C@H](CO)N(CC#N)[C@@H](COCOC)CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OCC5=CC=CC=C5

DOS

IR

Vibrations