Geometry & MOs

Info

ID:	282976
PubChem CID:	103949887
Reduced:	NOC16H27 (1)
Stoich.:	ABC16D27 (1)
Weight, g/mol:	270.176585
ΔH_f, kcal/mol:	-66.6
Dipole, Da:	2.57
IP(EA), eV:	-8.81(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-tert-butyl-1,3-thiazol-2-yl)methylamino]-3-methylpentan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CNC(CCO)C(C)(C)C

DOS

IR

Vibrations