Geometry & MOs

Info

ID:	168647
PubChem CID:	74998206
Reduced:	ON3C12H14 (2)
Stoich.:	AB3C12D14 (2)
Weight, g/mol:	519.101304
ΔH_f, kcal/mol:	3.39
Dipole, Da:	2.98
IP(EA), eV:	-9.4(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[7-(2-chlorophenyl)-4-methyl-7,8-dihydro-6H-quinolin-5-ylidene]amino]guanidine;methanesulfonic acid

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)CC(=O)NCC3=CC=CC=C3N4C=NC=N4

DOS

IR

Vibrations