Geometry & MOs

Info

ID:	373662
PubChem CID:	131318442
Reduced:	NSO3C5H5 (1)
Stoich.:	ABC3D5E5 (1)
Weight, g/mol:	213.15175
ΔH_f, kcal/mol:	-82.6
Dipole, Da:	4.52
IP(EA), eV:	-8.98(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-methyl-1-(5-methylnaphthalen-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

COC(=C1C(=O)N=CS1)O

DOS

IR

Vibrations