Geometry & MOs

Info

ID:	177821
PubChem CID:	76236427
Reduced:	O2S2N7H13C16 (1)
Stoich.:	A2B2C7D13E16 (1)
Weight, g/mol:	407.165663
ΔH_f, kcal/mol:	115.84
Dipole, Da:	15.07
IP(EA), eV:	-9.47(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[amino-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene]amino]oxy-N-(2,6-dimethylphenyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC2=NC(=O)N=C2C=C1)SC3=NN=C(N3N)C4=CC=CS4

DOS

IR

Vibrations