Geometry & MOs

Info

ID:	380203
PubChem CID:	134970565
Reduced:	NO6H19C20 (1)
Stoich.:	AB6C19D20 (1)
Weight, g/mol:	386.151809
ΔH_f, kcal/mol:	-111.13
Dipole, Da:	8.25
IP(EA), eV:	-9.5(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(1S,2R)-2-methoxycarbonyl-2,3-diphenylcyclopropyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2[C@H](C2(C(=O)OC)C(=O)OC)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations