Geometry & MOs

Info

ID:	222584
PubChem CID:	85305569
Reduced:	O3C10H19 (2)
Stoich.:	A3B10C19 (2)
Weight, g/mol:	374.256943
ΔH_f, kcal/mol:	-313.3
Dipole, Da:	2.92
IP(EA), eV:	-9.46(1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(dimethylamino)ethoxyiminomethyl]-5-[3-(hydroxymethyl)phenyl]-7a-methyl-2,3,4,5,6,7-hexahydro-1H-inden-3a-ol

Drug info:

PubChemData

Smile

CCOC(C)OCCCC1C(CCC2C(CCCC2O1)O)(C)OCOC

DOS

IR

Vibrations