Geometry & MOs

Info

ID:	46421
PubChem CID:	10524350
Reduced:	OSN4C21H32 (1)
Stoich.:	ABC4D21E32 (1)
Weight, g/mol:	388.218219
ΔH_f, kcal/mol:	40.18
Dipole, Da:	6.99
IP(EA), eV:	-9.22(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(diethoxymethyl)indole-5-carbonitrile

Drug info:

PubChemData

Smile

CCCCCCCCCCCCN1/C(=N\N=O)/SCC(=N1)C2=CC=CC=C2

DOS

IR

Vibrations