Geometry & MOs

Info

ID:	149253
PubChem CID:	53788925
Reduced:	OSN5C15H17 (1)
Stoich.:	ABC5D15E17 (1)
Weight, g/mol:	254.174276
ΔH_f, kcal/mol:	33.09
Dipole, Da:	6.48
IP(EA), eV:	-8.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-imino-N-[4-(3-iminobutanoylamino)butyl]butanamide

Drug info:

PubChemData

Smile

CC1=CC(=O)NC2=C1C(=CC(=C2)C3=CSC=C3)NNC(N)N

DOS

IR

Vibrations