Geometry & MOs

Info

ID:	40302
PubChem CID:	8143901
Reduced:	SN4C20H22 (1)
Stoich.:	AB4C20D22 (1)
Weight, g/mol:	323.08848
ΔH_f, kcal/mol:	92.66
Dipole, Da:	3.44
IP(EA), eV:	-8.18(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-N-(4-bromophenyl)-2-hexylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(=NN(C2=S)CN3CCCC3)C4=CC=CC=C4

DOS

IR

Vibrations