Geometry & MOs

Info

ID:	143865
PubChem CID:	53272189
Reduced:	OSN2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	364.06088
ΔH_f, kcal/mol:	-4.76
Dipole, Da:	3.62
IP(EA), eV:	-8.76(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]-1-cyclohexylmethanamine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=CN=C(S2)CNC3CCCC3

DOS

IR

Vibrations