Geometry & MOs

Info

ID:	238628
PubChem CID:	92763446
Reduced:	SN2C8H14 (1)
Stoich.:	AB2C8D14 (1)
Weight, g/mol:	170.08777
ΔH_f, kcal/mol:	20.51
Dipole, Da:	1.11
IP(EA), eV:	-9.11(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(1,3-thiazol-4-yl)ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CCCN[C@H](C)C1=CSC=N1

DOS

IR

Vibrations