Geometry & MOs

Info

ID:	199725
PubChem CID:	79287377
Reduced:	O2N4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	17.37
Dipole, Da:	2.54
IP(EA), eV:	-8.87(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[(1-methylimidazol-2-yl)methyl]-2-(prop-2-ynylamino)acetamide

Drug info:

PubChemData

Smile

COCCN1C=C(C=N1)NC(=O)CNCC#C

DOS

IR

Vibrations