Geometry & MOs

Info

ID:	183444
PubChem CID:	77021774
Reduced:	SO2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	243.194677
ΔH_f, kcal/mol:	-23.01
Dipole, Da:	2.74
IP(EA), eV:	-8.68(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hexyl-2-(N'-hydroxycarbamimidoyl)-3-methylbutanamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC(=C1)C(=NO)N)C(=O)C2CCCS2

DOS

IR

Vibrations