Geometry & MOs

Info

ID:	169993
PubChem CID:	75178902
Reduced:	O2N3C22H35 (1)
Stoich.:	A2B3C22D35 (1)
Weight, g/mol:	395.133734
ΔH_f, kcal/mol:	-86.52
Dipole, Da:	2.53
IP(EA), eV:	-8.04(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4-bis(ethylsulfanyl)-5-[4-(4-methoxyphenyl)triazol-1-yl]oxolan-2-yl]methanol

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C(C=C2C=C1)OC)NCC(C)(N(CC(C)C)CC(C)C)O

DOS

IR

Vibrations