Geometry & MOs

Info

ID:	297679
PubChem CID:	117625458
Reduced:	ON2C12H14 (2)
Stoich.:	AB2C12D14 (2)
Weight, g/mol:	368.200097
ΔH_f, kcal/mol:	28.52
Dipole, Da:	3.28
IP(EA), eV:	-8.29(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(4S)-2-methyl-4-naphthalen-2-yl-3,4-dihydro-1H-isoquinolin-7-yl]-1,2-dihydropyridazin-3-amine

Drug info:

PubChemData

Smile

CCCCCN1C(=O)C(=C(N1)C)N/N=C/2\C=CC=C(C2=O)/C=C/C3=CC=CC=C3C

DOS

IR

Vibrations