Geometry & MOs

Info

ID:	329499
PubChem CID:	126737585
Reduced:	O3N4C23H36 (1)
Stoich.:	A3B4C23D36 (1)
Weight, g/mol:	138.06808
ΔH_f, kcal/mol:	-148.62
Dipole, Da:	4.75
IP(EA), eV:	-8.2(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-ethynyl-5-methylideneoxolan-2-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CC(C1)NC2=C(C=C(C=C2)N(C)C(=O)C3CCCCC3)N

DOS

IR

Vibrations