Geometry & MOs

Info

ID:	374071
PubChem CID:	131323333
Reduced:	ClOSH9C12 (1)
Stoich.:	ABCD9E12 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	9.98
Dipole, Da:	3.59
IP(EA), eV:	-9.13(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-morpholin-4-yl-5-propylpyrrol-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CSC=C2)C(=O)CCl

DOS

IR

Vibrations