Geometry & MOs

Info

ID:	268175
PubChem CID:	103598229
Reduced:	O4N5H17C18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	390.144038
ΔH_f, kcal/mol:	-13.35
Dipole, Da:	8.17
IP(EA), eV:	-9.54(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3-(furan-2-yl)-2-(5-phenyltetrazol-1-yl)prop-2-enamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC)NC(=O)C(=CC1=CC=CO1)N2C(=NN=N2)C3=CC=CC=C3

DOS

IR

Vibrations