Geometry & MOs

Info

ID:	270127
PubChem CID:	103629558
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	288.16602
ΔH_f, kcal/mol:	-62.79
Dipole, Da:	3.68
IP(EA), eV:	-9.24(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-1-(4-ethylphenyl)methanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNC(C)C(=O)NCCC(C)C

DOS

IR

Vibrations