Geometry & MOs

Info

ID:	183099
PubChem CID:	76979609
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	264.158626
ΔH_f, kcal/mol:	-92.91
Dipole, Da:	5.27
IP(EA), eV:	-8.98(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4,6-dimethyl-2-(1,4-oxazepan-4-yl)pyridine-3-carboximidamide

Drug info:

PubChemData

Smile

C1CN(CCOC1)CC2=CC=CC=C2C=CC(=O)O

DOS

IR

Vibrations