Geometry & MOs

Info

ID:	319942
PubChem CID:	126657639
Reduced:	N2O4C17H30 (1)
Stoich.:	A2B4C17D30 (1)
Weight, g/mol:	292.109944
ΔH_f, kcal/mol:	-210.43
Dipole, Da:	2.4
IP(EA), eV:	-9.09(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-tricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-ynyl carbonate

Drug info:

PubChemData

Smile

C[C@@H]([C@@H](C(=O)N1[C@H]2CCC[C@H]2CC1C(C)C)NC(=O)OC)OC

DOS

IR

Vibrations