Geometry & MOs

Info

ID:	250474
PubChem CID:	103096903
Reduced:	NOSC10H23 (1)
Stoich.:	ABCD10E23 (1)
Weight, g/mol:	305.132861
ΔH_f, kcal/mol:	-83.93
Dipole, Da:	4.4
IP(EA), eV:	-8.18(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-butyl-4-chloro-1H-imidazol-5-yl)methylamino]-2-methyl-3-methylsulfanylpropan-2-ol

Drug info:

PubChemData

Smile

CCCCCNCC(C)(CSC)O

DOS

IR

Vibrations