Geometry & MOs

Info

ID:	442807
PubChem CID:	135256355
Reduced:	O3N7C23H23 (1)
Stoich.:	A3B7C23D23 (1)
Weight, g/mol:	148.100048
ΔH_f, kcal/mol:	15.88
Dipole, Da:	7.26
IP(EA), eV:	-9.23(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethenyl-5-propan-2-ylpyridazine

Drug info:

PubChemData

Smile

COCC1=CC=CC(=N1)CN2C=C(N=N2)C3=NC(=NC(=C3)C4=CC=CC(=C4)CCC(=O)O)N

DOS

IR

Vibrations