Geometry & MOs

Info

ID:	382460
PubChem CID:	134973625
Reduced:	O3C19H30 (1)
Stoich.:	A3B19C30 (1)
Weight, g/mol:	334.225643
ΔH_f, kcal/mol:	-153.85
Dipole, Da:	3.36
IP(EA), eV:	-10.08(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6,6,7-trimethyl-1-[5-(oxiran-2-yl)-3,4-dihydropyrazol-5-yl]-2,3,4,5,7,7a-hexahydro-1H-indene-3a-carboxylate

Drug info:

PubChemData

Smile

CC1C2[C@@H](CCC2(CCC1(C)C)C(=O)OC)C3(CC3)C(=O)C

DOS

IR

Vibrations