Geometry & MOs

Info

ID:	235206
PubChem CID:	92304219
Reduced:	N8C19H22 (1)
Stoich.:	A8B19C22 (1)
Weight, g/mol:	416.207548
ΔH_f, kcal/mol:	195.02
Dipole, Da:	7.48
IP(EA), eV:	-8.28(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(2R)-3-methylbutan-2-yl]-3-(1-methylindol-3-yl)-3-[3-(trifluoromethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C=NC2=NN=NN2/N=C\C3=CC=C(C=C3)N(C)C

DOS

IR

Vibrations