Geometry & MOs

Info

ID:	309584
PubChem CID:	126549570
Reduced:	OSN2C5H10 (1)
Stoich.:	ABC2D5E10 (1)
Weight, g/mol:	502.262028
ΔH_f, kcal/mol:	-32.47
Dipole, Da:	3.14
IP(EA), eV:	-9.38(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2-methoxy-3-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide

Drug info:

PubChemData

Smile

CCCSC(=NC=O)N

DOS

IR

Vibrations