Geometry & MOs

Info

ID:	57208
PubChem CID:	22395481
Reduced:	O2N7H13C14 (1)
Stoich.:	A2B7C13D14 (1)
Weight, g/mol:	245.162708
ΔH_f, kcal/mol:	113.59
Dipole, Da:	3.46
IP(EA), eV:	-9.39(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(1-aminopropoxy)propoxy]propyl prop-2-enoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2CNC=O.C1=CC=C2C(=C1)N=NN2O

DOS

IR

Vibrations