Geometry & MOs

Info

ID:	175877
PubChem CID:	75964531
Reduced:	Cl2O2N5H21C23 (1)
Stoich.:	A2B2C5D21E23 (1)
Weight, g/mol:	464.278741
ΔH_f, kcal/mol:	-17.08
Dipole, Da:	4.75
IP(EA), eV:	-9.17(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl N-[1-acetyl-2-methyl-6-[6-(piperidin-1-ylmethyl)pyridin-3-yl]-3,4-dihydro-2H-quinolin-4-yl]carbamate

Drug info:

PubChemData

Smile

CC1=C(NC=C1)C(=O)NC(CC2=CC(=C(C=C2)Cl)Cl)C(=O)NCC3=CN=C4C(=C3)C=CN4

DOS

IR

Vibrations