Geometry & MOs

Info

ID:	445915
PubChem CID:	135269928
Reduced:	NC13H18 (2)
Stoich.:	AB13C18 (2)
Weight, g/mol:	377.165188
ΔH_f, kcal/mol:	189.6
Dipole, Da:	3.29
IP(EA), eV:	-9.0(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-amino-6-(3-fluoro-4-methylcyclohepta-1,3,6-trien-1-yl)pyrazin-2-yl]methyl (Z)-N-methylidenebenzenecarbohydrazonate

Drug info:

PubChemData

Smile

CC(C)C(C)(C)C1CC(C=C1)C(=N)CC(=C)C(C)N(C)C(C#C)C2=C=CC=C2

DOS

IR

Vibrations