Geometry & MOs

Info

ID:	197906
PubChem CID:	79014394
Reduced:	ClO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	299.166748
ΔH_f, kcal/mol:	-86.24
Dipole, Da:	4.18
IP(EA), eV:	-9.21(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-5-(methylaminomethyl)-N-(3-methylbutyl)-1H-pyrrole-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(C=C1)Cl)[C@H](CCCO2)O

DOS

IR

Vibrations