Geometry & MOs

Info

ID:	32263
PubChem CID:	6436240
Reduced:	NC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	162.88
Dipole, Da:	6.6
IP(EA), eV:	-5.82(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1S,14R,15E,18R)-15-ethylidene-17-formyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate

Drug info:

PubChemData

Smile

C/C=C\1/CN2CC[C@H]1C(=C)C3=C(C2)C=C4C=CNC4=C3

DOS

IR

Vibrations