Geometry & MOs

Info

ID:	185470
PubChem CID:	77302680
Reduced:	BrN2O4C22H25 (1)
Stoich.:	AB2C4D22E25 (1)
Weight, g/mol:	508.13616
ΔH_f, kcal/mol:	-73.67
Dipole, Da:	3.98
IP(EA), eV:	-9.46(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(4-bromophenyl)-3-N-(1-methoxy-3-phenylpropan-2-yl)spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2,3-dicarboxamide

Drug info:

PubChemData

Smile

COC(=O)CCNC(=O)C1C2C=CC(C1C(=O)NCC3=CC=C(C=C3)Br)C24CC4

DOS

IR

Vibrations