Geometry & MOs

Info

ID:	172139
PubChem CID:	75471155
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	392.111853
ΔH_f, kcal/mol:	-34.99
Dipole, Da:	8.34
IP(EA), eV:	-8.5(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl]-3-ethyl-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NN(C=C1C(=O)NC2=CC=CC=C2NC(=O)N3CCCC3)C

DOS

IR

Vibrations