Geometry & MOs

Info

ID:	382091
PubChem CID:	134973020
Reduced:	NO2C25H26 (2)
Stoich.:	AB2C25D26 (2)
Weight, g/mol:	300.220164
ΔH_f, kcal/mol:	-58.4
Dipole, Da:	5.11
IP(EA), eV:	-7.58(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

Smile

C[C@@]12C([C@@H](C[C@]1(O)C3=CC=C/C(=C\4/C(=O)C(=C5C(=C4)C=CC=C5)C6=C7C(=C/C(=C\8/NC(=CC=C8)[C@@]9([C@]1(C([C@@H](C9)CC1)(C)C)C)O)/C6=O)C=CC=C7)/N3)CC2)(C)C

DOS

IR

Vibrations