Geometry & MOs

Info

ID:	202197
PubChem CID:	79641153
Reduced:	NO2C16H33 (1)
Stoich.:	AB2C16D33 (1)
Weight, g/mol:	302.123504
ΔH_f, kcal/mol:	-151.49
Dipole, Da:	2.63
IP(EA), eV:	-9.17(2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[[5-(dimethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(methylamino)cyclohexyl]methanol

Drug info:

PubChemData

Smile

CCCNC1(CCCC(C1)OCCC(C)(C)C)CO

DOS

IR

Vibrations