Geometry & MOs

Info

ID:	297700
PubChem CID:	117626126
Reduced:	NO8C34H55 (1)
Stoich.:	AB8C34D55 (1)
Weight, g/mol:	503.397459
ΔH_f, kcal/mol:	-435.79
Dipole, Da:	2.38
IP(EA), eV:	-9.18(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methyl-2-bicyclo[2.2.1]heptanyl) 2-[4-(3-hydroxycyclohexyl)pentyl]-6-(2-oxopyrrolidin-1-yl)octanoate

Drug info:

PubChemData

Smile

CCC(CCCC(CCCC(C)(C)CC(=O)OCCOC(=O)CC(=O)C)C(=O)OC1CC2CCC1(C2)C)N3CCCC3=O

DOS

IR

Vibrations