Geometry & MOs

Info

ID:	231671
PubChem CID:	87574417
Reduced:	SN2O3C17H18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	347.118925
ΔH_f, kcal/mol:	-70.97
Dipole, Da:	2.18
IP(EA), eV:	-8.76(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1,6-naphthyridin-2-yl(diphenyl)methyl]azanium;chloride

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=C(C=C2)C[C@@H](C(=S)N)NC(=O)O

DOS

IR

Vibrations