Geometry & MOs

Info

ID:	395458
PubChem CID:	135025522
Reduced:	NO8C20H23 (1)
Stoich.:	AB8C20D23 (1)
Weight, g/mol:	299.100502
ΔH_f, kcal/mol:	-285.98
Dipole, Da:	2.95
IP(EA), eV:	-9.73(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-O-ethyl 1-O-methyl (1R,2S,3S)-1-formamido-3-[(Z)-3-methoxy-3-oxoprop-1-enyl]cyclopropane-1,2-dicarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1[C@@H]([C@@]1(C(=O)OC)NC(=O)OCC2=CC=CC=C2)/C=C\C(=O)OC

DOS

IR

Vibrations