Geometry & MOs

Info

ID:	381925
PubChem CID:	134972790
Reduced:	OC14H22 (2)
Stoich.:	AB14C22 (2)
Weight, g/mol:	356.116092
ΔH_f, kcal/mol:	-145.85
Dipole, Da:	1.98
IP(EA), eV:	-9.01(1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

13-[(4-methoxyphenyl)methyl]-11-oxa-13,14-diazatetracyclo[8.7.0.03,8.012,16]heptadeca-1,3,5,7,9,12(16),14-heptaen-17-one

Drug info:

PubChemData

Smile

C[C@H]1CC[C@@]2(C3CC[C@]4(C(C3CC=C2C1)CC5C4C(C6(O5)CCC(CO6)C)C)C)C

DOS

IR

Vibrations