Geometry & MOs

Info

ID:	22016
PubChem CID:	595060
Reduced:	ON6C26H28 (1)
Stoich.:	AB6C26D28 (1)
Weight, g/mol:	440.23246
ΔH_f, kcal/mol:	118.36
Dipole, Da:	5.21
IP(EA), eV:	-8.42(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(diethylaminomethyl)-4-methoxyphenyl]-6-(3-phenylphenyl)-1,2,4,5-tetrazin-3-amine

Drug info:

PubChemData

Smile

CCN(CC)CC1=C(C=CC(=C1)NC2=NN=C(N=N2)C3=CC=CC(=C3)C4=CC=CC=C4)OC

DOS

IR

Vibrations