Geometry & MOs

Info

ID:	43006
PubChem CID:	10317707
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	381.147727
ΔH_f, kcal/mol:	-61.33
Dipole, Da:	10.58
IP(EA), eV:	-8.54(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-morpholin-4-ylbenzoyl)pyrrolo[1,2-a]quinoline-3-carbonitrile

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=C(O1)C)NC2=C(C(=O)C2=O)NC3=CC=CC(=C3)C(=O)N(C)C

DOS

IR

Vibrations