Geometry & MOs

Info

ID:	430763
PubChem CID:	135170830
Reduced:	OSN5C20H25 (1)
Stoich.:	ABC5D20E25 (1)
Weight, g/mol:	383.177982
ΔH_f, kcal/mol:	22.58
Dipole, Da:	4.18
IP(EA), eV:	-8.67(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[3-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexyl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC[C@H](C1)NC2=NN=C(S2)C)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations