Geometry & MOs

Info

ID:	132026
PubChem CID:	51293738
Reduced:	N3O4C19H31 (1)
Stoich.:	A3B4C19D31 (1)
Weight, g/mol:	339.107519
ΔH_f, kcal/mol:	-209.51
Dipole, Da:	2.01
IP(EA), eV:	-9.43(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(4-ethylphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)CN2C(=O)C3(CCC(CC3)C(C)(C)C)NC2=O

DOS

IR

Vibrations