Geometry & MOs

Info

ID:	255251
PubChem CID:	103130914
Reduced:	SN3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	253.161269
ΔH_f, kcal/mol:	16.76
Dipole, Da:	3.79
IP(EA), eV:	-8.32(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylsulfanyl-N-methyl-1-(1-methylpyrazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

CCNC(CSC1CCCC1)C2=NN(C=C2)C

DOS

IR

Vibrations