Geometry & MOs

Info

ID:	234401
PubChem CID:	92298345
Reduced:	NO4C18H25 (1)
Stoich.:	AB4C18D25 (1)
Weight, g/mol:	381.114713
ΔH_f, kcal/mol:	-182.07
Dipole, Da:	4.2
IP(EA), eV:	-9.53(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]phenyl]-(1-methylimidazol-2-yl)methanone

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)O[C@@H](C)C(=O)NC2CCCCC2

DOS

IR

Vibrations