Geometry & MOs

Info

ID:	220289
PubChem CID:	85177261
Reduced:	NO4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	-204.94
Dipole, Da:	3.53
IP(EA), eV:	-9.88(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(4-cyanophenyl)-1,2,2-trimethylcyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1C(CCCC1O)C(=O)OC

DOS

IR

Vibrations