Geometry & MOs

Info

ID:	405118
PubChem CID:	135072642
Reduced:	FOSH11C14 (1)
Stoich.:	ABCD11E14 (1)
Weight, g/mol:	325.06774
ΔH_f, kcal/mol:	-40.14
Dipole, Da:	1.74
IP(EA), eV:	-9.07(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethylpentan-3-yl (NE)-N-[(4-bromophenyl)methylidene]carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)SC(=O)CC2=CC=C(C=C2)F

DOS

IR

Vibrations