Geometry & MOs

Info

ID:	399636
PubChem CID:	135041398
Reduced:	OC19H34 (1)
Stoich.:	AB19C34 (1)
Weight, g/mol:	277.002049
ΔH_f, kcal/mol:	-86.8
Dipole, Da:	1.61
IP(EA), eV:	-9.56(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(trifluoromethylsulfonyl)indole-3-carbaldehyde

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H](C(C1)C(/C=C(\C)/CCCC=C)O)C(C)C

DOS

IR

Vibrations