Geometry & MOs

Info

ID:	183109
PubChem CID:	76979904
Reduced:	N3O4C14H21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-99.2
Dipole, Da:	3.54
IP(EA), eV:	-9.19(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(N'-hydroxycarbamimidoyl)-N-(3-methoxypropyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCCOC)C(=O)COC1=CC=CC=C1C(=NO)N

DOS

IR

Vibrations