Geometry & MOs

Info

ID:	49027
PubChem CID:	11528629
Reduced:	O5C10H18 (1)
Stoich.:	A5B10C18 (1)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-248.91
Dipole, Da:	2.9
IP(EA), eV:	-10.15(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propan-2-yloxy-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)O[C@H]1C[C@H](C[C@H](C1)OCOC)O

DOS

IR

Vibrations