Geometry & MOs

Info

ID:	198457
PubChem CID:	79103306
Reduced:	BrFN2C15H16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	221.152812
ΔH_f, kcal/mol:	20.93
Dipole, Da:	4.6
IP(EA), eV:	-8.94(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[cyclopropyl(methylamino)methyl]pyrrol-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

C1CC1C(C2=CN(C=C2)CC3=CC(=C(C=C3)F)Br)N

DOS

IR

Vibrations