Geometry & MOs

Info

ID:	208037
PubChem CID:	80482789
Reduced:	BrNO3S3C10H10 (1)
Stoich.:	ABC3D3E10F10 (1)
Weight, g/mol:	139.1361
ΔH_f, kcal/mol:	-58.19
Dipole, Da:	3.75
IP(EA), eV:	-9.42(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-4-methylpent-3-en-2-amine

Drug info:

PubChemData

Smile

C1=CSC(=C1Br)CNS(=O)(=O)C2=CC=C(S2)CO

DOS

IR

Vibrations