Geometry & MOs

Info

ID:	186992
PubChem CID:	77513093
Reduced:	FO3N6C23H31 (1)
Stoich.:	AB3C6D23E31 (1)
Weight, g/mol:	504.175516
ΔH_f, kcal/mol:	-138.03
Dipole, Da:	3.5
IP(EA), eV:	-8.57(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[amino-[2-[2-[5-(2,5-difluorophenyl)-3-(2-methoxypropanoyl)-2-phenyl-1,3,4-thiadiazol-2-yl]ethyl]hydrazinyl]methylidene]acetamide

Drug info:

PubChemData

Smile

CC1CN(CCN1C(CCC(=O)N)O)CC2=C(C(=CC=C2)NC(=O)NC3=CN=C(C=C3)C)F

DOS

IR

Vibrations