Geometry & MOs

Info

ID:	271599
PubChem CID:	103685239
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	283.103085
ΔH_f, kcal/mol:	-7.72
Dipole, Da:	4.91
IP(EA), eV:	-9.18(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(naphthalen-1-ylmethylamino)-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNCC(C2=CSC=C2)O)[N+](=O)[O-]

DOS

IR

Vibrations