Geometry & MOs

Info

ID:	140739
PubChem CID:	52750218
Reduced:	BrFN2O3C19H22 (1)
Stoich.:	ABC2D3E19F22 (1)
Weight, g/mol:	376.118985
ΔH_f, kcal/mol:	-125.36
Dipole, Da:	2.5
IP(EA), eV:	-9.12(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl N-[3-[(5-chloro-2-methoxybenzoyl)amino]phenyl]carbamate

Drug info:

PubChemData

Smile

C1C[C@H](OC1)CN(CCC(=O)NC2=C(C=C(C=C2)Br)F)CC3=CC=CO3

DOS

IR

Vibrations