Geometry & MOs

Info

ID:	58292
PubChem CID:	24697529
Reduced:	ClON3H12C13 (1)
Stoich.:	ABC3D12E13 (1)
Weight, g/mol:	174.11907
ΔH_f, kcal/mol:	26.38
Dipole, Da:	0.74
IP(EA), eV:	-9.38(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dipropylamino)ethanethioamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)OC2=NC=CC(=C2)C(=N)N

DOS

IR

Vibrations