Geometry & MOs

Info

ID:	271598
PubChem CID:	103685238
Reduced:	NSO2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	292.088164
ΔH_f, kcal/mol:	-6.38
Dipole, Da:	1.24
IP(EA), eV:	-8.99(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methyl-3-nitrophenyl)methylamino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=C(O2)CNCC(C3=CSC=C3)O

DOS

IR

Vibrations