Geometry & MOs

Info

ID:	144382
PubChem CID:	53359319
Reduced:	N2O5C23H30 (1)
Stoich.:	A2B5C23D30 (1)
Weight, g/mol:	374.141262
ΔH_f, kcal/mol:	-148.07
Dipole, Da:	4.42
IP(EA), eV:	-9.48(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-[(E)-3-[1-(dimethylsulfamoyl)imidazol-4-yl]prop-2-enyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1(N([C@@H](CO1)[C@@H]2[C@@H](C(=O)N2CC3=CC=CC=C3)OCC#C)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations