Geometry & MOs

Info

ID:	191315
PubChem CID:	78129649
Reduced:	O13N14C54H80 (1)
Stoich.:	A13B14C54D80 (1)
Weight, g/mol:	140.047344
ΔH_f, kcal/mol:	-565.69
Dipole, Da:	8.4
IP(EA), eV:	-9.04(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethynyl-2-methoxy-2,3-dihydrofuran-3-ol

Drug info:

Smile

CCC(C)C(C(=O)NC(CCCN=C(N)N)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CN=CN1)C(=O)NC(CC2=CC=CC=C2)C(=O)O)NC(=O)CNC(=O)C(CC3=CC=C(C=C3)O)NC(=O)C(C(C)C)N

DOS

IR

Vibrations