Geometry & MOs

Info

ID:	130466
PubChem CID:	51090913
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	275.152144
ΔH_f, kcal/mol:	-68.06
Dipole, Da:	3.61
IP(EA), eV:	-9.19(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethoxyethoxy)-N-(3-phenylprop-2-ynyl)propanamide

Drug info:

PubChemData

Smile

CCN(CC1CCOC1)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3

DOS

IR

Vibrations