Geometry & MOs

Info

ID:	310990
PubChem CID:	126588711
Reduced:	BrNO3C20H24 (1)
Stoich.:	ABC3D20E24 (1)
Weight, g/mol:	377.18025
ΔH_f, kcal/mol:	-111.41
Dipole, Da:	4.07
IP(EA), eV:	-8.24(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[3-(difluoromethyl)-2-[(4-ethyl-2,5-dimethylphenoxy)methyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CCC1=C(C=C(C(=C1)C)OCC2=C(C=CC=C2Br)NC(=O)OCC)C

DOS

IR

Vibrations