Geometry & MOs

Info

ID:	217624
PubChem CID:	85088116
Reduced:	N2O5C20H34 (1)
Stoich.:	A2B5C20D34 (1)
Weight, g/mol:	382.172151
ΔH_f, kcal/mol:	-277.23
Dipole, Da:	6.23
IP(EA), eV:	-10.1(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-benzylidenehexacyclo[14.7.0.01,9.02,7.010,15.017,22]tricosa-2,4,6,10,12,14,17,19,21-nonaene

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CCN2C(C(=O)NC2=O)CCCCCCCC(=O)O)O

DOS

IR

Vibrations