Geometry & MOs

Info

ID:	282205
PubChem CID:	103918678
Reduced:	BrN3C16H22 (1)
Stoich.:	AB3C16D22 (1)
Weight, g/mol:	364.04479
ΔH_f, kcal/mol:	33.26
Dipole, Da:	2.7
IP(EA), eV:	-8.47(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(dimethylamino)propyl]-4-fluoro-2-iodo-N-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NCC2=CN(N=C2C(C)(C)C)C

DOS

IR

Vibrations