Geometry & MOs

Info

ID:	271591
PubChem CID:	103685133
Reduced:	BrNSO2C15H20 (1)
Stoich.:	ABCD2E15F20 (1)
Weight, g/mol:	310.99795
ΔH_f, kcal/mol:	-12.9
Dipole, Da:	2.79
IP(EA), eV:	-8.67(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-bromophenyl)methylamino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC(C(CO)SC)NCC1=C(C=CC(=C1)Br)OCC#C

DOS

IR

Vibrations