Geometry & MOs

Info

ID:	438041
PubChem CID:	135227554
Reduced:	NH13C17 (1)
Stoich.:	AB13C17 (1)
Weight, g/mol:	299.1674
ΔH_f, kcal/mol:	183.55
Dipole, Da:	2.44
IP(EA), eV:	-8.43(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3E,5Z)-hepta-1,3,5-trien-4-yl]-N-methylanthracen-9-amine

Drug info:

PubChemData

Smile

CN(C1=CC#CC=C1)C2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations