Geometry & MOs

Info

ID:	234884
PubChem CID:	92303653
Reduced:	SN2O2C22H32 (1)
Stoich.:	AB2C2D22E32 (1)
Weight, g/mol:	394.225643
ΔH_f, kcal/mol:	-109.97
Dipole, Da:	4.18
IP(EA), eV:	-8.89(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(7-ethyl-1H-indol-3-yl)-3-(3-methoxyphenyl)-N-(3-methoxypropyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)N2[C@H](CS[C@H]2C3CCCCC3)C(=O)NCC(C)C

DOS

IR

Vibrations