Geometry & MOs

Info

ID:	278871
PubChem CID:	103839261
Reduced:	SN2O4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	323.05209
ΔH_f, kcal/mol:	-107.41
Dipole, Da:	4.38
IP(EA), eV:	-9.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[(1-cyclopropylcyclopropyl)methyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(O1)C(=O)NCC2(CC2)C3CC3)S(=O)(=O)N

DOS

IR

Vibrations