Geometry & MOs

Info

ID:	282346
PubChem CID:	103922986
Reduced:	NSO4C14H23 (1)
Stoich.:	ABC4D14E23 (1)
Weight, g/mol:	343.97496
ΔH_f, kcal/mol:	-169.33
Dipole, Da:	2.63
IP(EA), eV:	-9.14(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-4-chlorophenyl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine

Drug info:

PubChemData

Smile

CC(CCOC)(CNCC1=CC=C(S1)CC(=O)OC)O

DOS

IR

Vibrations