Geometry & MOs

Info

ID:	186061
PubChem CID:	77385540
Reduced:	SiO2C33H60 (1)
Stoich.:	AB2C33D60 (1)
Weight, g/mol:	238.131742
ΔH_f, kcal/mol:	-237.87
Dipole, Da:	3.7
IP(EA), eV:	-9.05(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-cyano-2-(ethylamino)-4-hydroxybicyclo[3.1.0]hexane-6-carboxylate

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)OC1CCC2(C3CCC4(C(C3=CC(C2C1)O)CCC4C(C)CCCC(C)C)C)C

DOS

IR

Vibrations