Geometry & MOs

Info

ID:	158519
PubChem CID:	56464121
Reduced:	OSN3C18H31 (1)
Stoich.:	ABC3D18E31 (1)
Weight, g/mol:	411.198048
ΔH_f, kcal/mol:	-65.97
Dipole, Da:	4.45
IP(EA), eV:	-8.62(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone

Drug info:

PubChemData

Smile

CC1CCCN(C1)CC(C)NC(=O)C2=C(N=C(S2)CC(C)C)C

DOS

IR

Vibrations