Geometry & MOs

Info

ID:	199726
PubChem CID:	79287487
Reduced:	ON4C13H18 (1)
Stoich.:	AB4C13D18 (1)
Weight, g/mol:	260.152478
ΔH_f, kcal/mol:	61.84
Dipole, Da:	1.0
IP(EA), eV:	-9.24(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(4-methoxyphenyl)methyl]-2-(prop-2-ynylamino)acetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN(C2CC2)C(=O)CNCC#C

DOS

IR

Vibrations