Geometry & MOs

Info

ID:	444477
PubChem CID:	135262591
Reduced:	O2N3C14H19 (2)
Stoich.:	A2B3C14D19 (2)
Weight, g/mol:	883.25219
ΔH_f, kcal/mol:	-115.34
Dipole, Da:	5.21
IP(EA), eV:	-8.78(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,2R)-2-(5-bromopyridin-2-yl)cyclopropane-1-carboxylate;5,10,15,20-tetraphenyl-21,22-dihydroporphyrin

Drug info:

PubChemData

Smile

C[C@@H]1COCCN1C2=NC(=NC(=C2)N3C4=C(C=C(C(=C4)C5CCN(CC5)C(=O)OC(C)(C)C)C)C=N3)OC

DOS

IR

Vibrations