Geometry & MOs

Info

ID:	440734
PubChem CID:	135231216
Reduced:	BrSO2N4H19C20 (1)
Stoich.:	ABC2D4E19F20 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	12.31
Dipole, Da:	1.16
IP(EA), eV:	-8.06(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,5-dimethyl-2-(1-methylcyclopropyl)hex-1-en-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CS(=O)NC2=CC=C(C=C2)NC(=O)NCC3=CC=NC=C3)Br

DOS

IR

Vibrations