Geometry & MOs

Info

ID:	405094
PubChem CID:	135072513
Reduced:	NO3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	373.167794
ΔH_f, kcal/mol:	0.74
Dipole, Da:	2.57
IP(EA), eV:	-9.04(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=C=C)[C@H]([C@H]1[C@H](C(=O)N1CC=C=C)OC2=CC=CC=C2)OC

DOS

IR

Vibrations