Geometry & MOs

Info

ID:	23187
PubChem CID:	602741
Reduced:	N2O3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-80.42
Dipole, Da:	3.08
IP(EA), eV:	-8.32(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 15-ethylidene-12-hydroxy-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate

Drug info:

PubChemData

Smile

CC=C1CN(C2CC3=C(C(CC1C2C(=O)OC)O)NC4=CC=CC=C34)C

DOS

IR

Vibrations