Geometry & MOs

Info

ID:	383503
PubChem CID:	134975259
Reduced:	N4O7C24H30 (1)
Stoich.:	A4B7C24D30 (1)
Weight, g/mol:	362.191336
ΔH_f, kcal/mol:	-279.44
Dipole, Da:	4.03
IP(EA), eV:	-9.54(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-7-phenylhept-2-ynoate

Drug info:

PubChemData

Smile

CC1=C(NC(=C1CCC(=O)OC)C(=O)N/C(=N/C(=O)OCC2=CC=CC=C2)/N)C(=O)OC(C)(C)C

DOS

IR

Vibrations