Geometry & MOs

Info

ID:	413825
PubChem CID:	135086775
Reduced:	BISO4C25H32 (1)
Stoich.:	ABCD4E25F32 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-219.97
Dipole, Da:	5.91
IP(EA), eV:	-8.56(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethoxypropan-2-yl 2-(1-methylindol-2-yl)acetate

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C(=C)C(CCCCC2=CC=CC=C2I)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations