Geometry & MOs

Info

ID:	234765
PubChem CID:	92303455
Reduced:	FSN2O2H21C24 (1)
Stoich.:	ABC2D2E21F24 (1)
Weight, g/mol:	410.220557
ΔH_f, kcal/mol:	-65.6
Dipole, Da:	4.39
IP(EA), eV:	-8.99(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(2,4-dimethoxyphenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N2[C@@H](SCC2=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)F)C

DOS

IR

Vibrations