Geometry & MOs

Info

ID:	159167
PubChem CID:	57264281
Reduced:	S2N7O9C19H29 (1)
Stoich.:	A2B7C9D19E29 (1)
Weight, g/mol:	264.089878
ΔH_f, kcal/mol:	-289.84
Dipole, Da:	10.65
IP(EA), eV:	-8.91(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-imidazol-1-ylphenoxy)benzaldehyde

Drug info:

PubChemData

Smile

C[C@@H]1[C@@H](C(=O)N1S(=O)(=O)O)NC(=O)C(=NOC(C)(C)C(=O)N(C)NC(=O)OC(C)(C)C)C2=CSC(=N2)N

DOS

IR

Vibrations