Geometry & MOs

Info

ID:	270045
PubChem CID:	103623891
Reduced:	SO2N3C15H27 (1)
Stoich.:	AB2C3D15E27 (1)
Weight, g/mol:	304.080097
ΔH_f, kcal/mol:	-84.93
Dipole, Da:	9.79
IP(EA), eV:	-9.08(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-chloro-1H-indol-3-yl)methyl]-1-(5-ethylthiophen-2-yl)methanamine

Drug info:

PubChemData

Smile

CCCCC(CC)CNC1=NC=C(C=C1)S(=O)(=O)N(C)C

DOS

IR

Vibrations