Geometry & MOs

Info

ID:	371113
PubChem CID:	127342515
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	363.194677
ΔH_f, kcal/mol:	-118.12
Dipole, Da:	7.16
IP(EA), eV:	-9.23(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-6-oxopiperidin-3-yl)-4-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CN1CC(CCC1=O)NC(=O)N2CCCC2C3CCCC3

DOS

IR

Vibrations