Geometry & MOs

Info

ID:	393613
PubChem CID:	135021204
Reduced:	NC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	328.313001
ΔH_f, kcal/mol:	62.15
Dipole, Da:	2.43
IP(EA), eV:	-8.0(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,9-dimethylpentacyclo[9.7.1.14,8.112,18.113,17]docosane

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/NC2=CC=CC=C2N

DOS

IR

Vibrations