Geometry & MOs

Info

ID:	272053
PubChem CID:	103721884
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	179.131014
ΔH_f, kcal/mol:	-158.39
Dipole, Da:	5.31
IP(EA), eV:	-9.48(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-pent-4-ynylpropanamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)CO)NC(=O)N2CCOCC2

DOS

IR

Vibrations