Geometry & MOs

Info

ID:	235216
PubChem CID:	92304231
Reduced:	FON2C22H25 (1)
Stoich.:	ABC2D22E25 (1)
Weight, g/mol:	352.195092
ΔH_f, kcal/mol:	-53.52
Dipole, Da:	4.79
IP(EA), eV:	-8.28(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-butyl-3-(3-fluorophenyl)-3-(1-methylindol-3-yl)propanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C[C@@H](C1=CC(=CC=C1)F)C2=CN(C3=CC=CC=C32)C

DOS

IR

Vibrations