Geometry & MOs

Info

ID:	327914
PubChem CID:	126691320
Reduced:	NC10H17 (1)
Stoich.:	AB10C17 (1)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	10.3
Dipole, Da:	1.68
IP(EA), eV:	-8.87(2.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-amino-3-(4-phenoxyphenyl)-2-(N'-piperidin-3-ylcarbamimidoyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CC23C1CCNCCC2C3

DOS

IR

Vibrations