Geometry & MOs

Info

ID:	52399
PubChem CID:	12015254
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	3.56
IP(EA), eV:	-8.14(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-4-(1-methyl-2,3-dihydroindol-3-yl)pentan-2-ol

Drug info:

PubChemData

Smile

CC(CC(C)(C)C1=CN(C2=CC=CC=C21)C)O

DOS

IR

Vibrations