Geometry & MOs

Info

ID:	183290
PubChem CID:	77001525
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	278.13789
ΔH_f, kcal/mol:	-31.85
Dipole, Da:	3.56
IP(EA), eV:	-8.9(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[4-(N'-hydroxycarbamimidoyl)phenyl]acetyl]amino]-N-methylpropanamide

Drug info:

PubChemData

Smile

CN1CCC(C1)CNC(=O)CC2=CC=C(C=C2)C(=NO)N

DOS

IR

Vibrations