Geometry & MOs

Info

ID:	424288
PubChem CID:	135122059
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	386.057053
ΔH_f, kcal/mol:	-104.01
Dipole, Da:	4.14
IP(EA), eV:	-8.03(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-amino-15-(4-chlorophenyl)-5-oxo-8-oxa-10,14-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1,3,6,9(17),10,12,15-heptaene-12-carbonitrile

Drug info:

PubChemData

Smile

CC(CCCNC(=O)NC1(CCC1)CO)NC2=C3C(=CC(=C2)OC)C=CC=N3

DOS

IR

Vibrations