Geometry & MOs

Info

ID:	160452
PubChem CID:	57309800
Reduced:	N2O7C34H48 (1)
Stoich.:	A2B7C34D48 (1)
Weight, g/mol:	198.198365
ΔH_f, kcal/mol:	-341.82
Dipole, Da:	3.52
IP(EA), eV:	-9.36(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(3,3,5-trimethylcyclohexyl)propan-2-ol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CCCC(=O)OCC1=CC=CC=C1)C(=O)O[C@@H](CCCCCCCC2=CC=CC=C2)CC(=O)N

DOS

IR

Vibrations