Geometry & MOs

Info

ID:	398788
PubChem CID:	135035416
Reduced:	FNOC18H18 (1)
Stoich.:	ABCD18E18 (1)
Weight, g/mol:	299.107692
ΔH_f, kcal/mol:	-26.03
Dipole, Da:	2.41
IP(EA), eV:	-8.08(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(1S)-1-(4-chlorophenyl)prop-2-enyl]-5-methoxy-2,3-dihydro-1H-indole

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N[C@@H](C2)[C@@H](C=C)C3=CC(=CC=C3)F

DOS

IR

Vibrations