Geometry & MOs

Info

ID:	182796
PubChem CID:	76938781
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	3.38
Dipole, Da:	3.79
IP(EA), eV:	-8.52(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl N-[[4-(N'-hydroxycarbamimidoyl)phenyl]methyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=NO)N)OCCC2=CC=CC=N2

DOS

IR

Vibrations