Geometry & MOs

Info

ID:	183179
PubChem CID:	76986232
Reduced:	N3O4C12H15 (1)
Stoich.:	A3B4C12D15 (1)
Weight, g/mol:	282.148061
ΔH_f, kcal/mol:	-110.39
Dipole, Da:	3.68
IP(EA), eV:	-9.85(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyridine-3-carboximidamide

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)C2C=CC(=O)N=N2)C(=O)O

DOS

IR

Vibrations