Geometry & MOs

Info

ID:	179618
PubChem CID:	76511434
Reduced:	N2O9C30H44 (1)
Stoich.:	A2B9C30D44 (1)
Weight, g/mol:	326.124212
ΔH_f, kcal/mol:	-375.73
Dipole, Da:	8.74
IP(EA), eV:	-9.01(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-[2-[2-(3-hydroxyprop-1-enyl)-1-methylindol-3-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=C(C(=C(C(=C2)CO)OC)C1)O)C)OC)OC(=O)N)C)C)O)OC

DOS

IR

Vibrations