Geometry & MOs

Info

ID:	55136
PubChem CID:	17389807
Reduced:	BrNSC9H12 (1)
Stoich.:	ABCD9E12 (1)
Weight, g/mol:	277.095023
ΔH_f, kcal/mol:	20.45
Dipole, Da:	2.95
IP(EA), eV:	-8.98(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-naphthalen-2-ylethanol;oxalic acid

Drug info:

PubChemData

Smile

C1CCNC(C1)C2=CC(=CS2)Br

DOS

IR

Vibrations