Geometry & MOs

Info

ID:	381560
PubChem CID:	134972333
Reduced:	NO8C28H41 (1)
Stoich.:	AB8C28D41 (1)
Weight, g/mol:	236.17763
ΔH_f, kcal/mol:	-345.88
Dipole, Da:	6.01
IP(EA), eV:	-8.99(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl (1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(N([C@H](CO1)C[C@]2([C@@H](OC(O2)(C)C)[C@@H](C=C)OCC3=CC=C(C=C3)OC)C=O)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations