Geometry & MOs

Info

ID:	196626
PubChem CID:	78855860
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	255.125929
ΔH_f, kcal/mol:	-64.79
Dipole, Da:	6.59
IP(EA), eV:	-9.01(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(2-hydroxypropyl)-3-naphthalen-1-ylprop-2-enamide

Drug info:

PubChemData

Smile

CC1=CN2C=C(N=C2C=C1)COC3=CC=CC(=C3)C(=O)NCC(C)O

DOS

IR

Vibrations