Geometry & MOs

Info

ID:	194457
PubChem CID:	78539471
Reduced:	SN3O3C18H23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	371.01571
ΔH_f, kcal/mol:	-102.43
Dipole, Da:	4.73
IP(EA), eV:	-9.32(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-bromobenzoate

Drug info:

PubChemData

Smile

CCN(CC(=C)C)C(=O)CN1C(=O)C2(CCCC3=C2C=CS3)NC1=O

DOS

IR

Vibrations