Geometry & MOs

Info

ID:	390403
PubChem CID:	134998995
Reduced:	ClNO4H18C23 (1)
Stoich.:	ABC4D18E23 (1)
Weight, g/mol:	324.154557
ΔH_f, kcal/mol:	-99.14
Dipole, Da:	1.75
IP(EA), eV:	-8.33(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,1aR,6R,6aS)-6-(4-methoxyphenyl)-1-trimethylsilyl-1a,6a-dihydro-1H-cyclopropa[a]inden-6-ol

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CN2C1=C(C3=CC=CC=C32)C)C(=O)C4=C(C=CC(=C4)Cl)O

DOS

IR

Vibrations