Geometry & MOs

Info

ID:	344041
PubChem CID:	127267217
Reduced:	O2F3N5C12H12 (1)
Stoich.:	A2B3C5D12E12 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-121.49
Dipole, Da:	5.07
IP(EA), eV:	-9.38(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(2,6-dimethylphenyl)carbamoylamino]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCONC(=O)NC1=CN(N=N1)C2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations