Geometry & MOs

Info

ID:	199991
PubChem CID:	79328992
Reduced:	BrFNC14H17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	256.193949
ΔH_f, kcal/mol:	-3.86
Dipole, Da:	1.29
IP(EA), eV:	-9.16(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1-methyl-2,3-dihydroindol-5-yl)methylidene]butyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC(=CC1=C(C=CC(=C1)Br)F)CNC2CC2

DOS

IR

Vibrations