Geometry & MOs

Info

ID:	235188
PubChem CID:	92304196
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	410.212491
ΔH_f, kcal/mol:	-70.53
Dipole, Da:	7.25
IP(EA), eV:	-8.67(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(3-chlorophenyl)-3-(1-ethylindol-3-yl)-N-hexylpropanamide

Drug info:

PubChemData

Smile

CN(C)C(=O)N1C[C@@H]2C[C@H](C1)C3=CC=CC(=O)N3C2

DOS

IR

Vibrations