Geometry & MOs

Info

ID:	405563
PubChem CID:	135074466
Reduced:	O3C18H22 (1)
Stoich.:	A3B18C22 (1)
Weight, g/mol:	391.05718
ΔH_f, kcal/mol:	-42.22
Dipole, Da:	1.44
IP(EA), eV:	-8.74(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-1-bromo-2,3-diphenyl-N,N-bis(prop-2-ynyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C/C(=C\COC)/OC/C=C(\C1=CC=CC=C1)/OCCC#C

DOS

IR

Vibrations