Geometry & MOs

Info

ID:	339563
PubChem CID:	127261553
Reduced:	N5O5C18H19 (1)
Stoich.:	A5B5C18D19 (1)
Weight, g/mol:	248.163711
ΔH_f, kcal/mol:	8.45
Dipole, Da:	4.94
IP(EA), eV:	-9.3(-2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-(4-carbamimidoylphenyl)hexanamide

Drug info:

PubChemData

Smile

CCCC/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C(=O)NC2=CC=CC=C2

DOS

IR

Vibrations