Geometry & MOs

Info

ID:	77150
PubChem CID:	48425859
Reduced:	N4O4C19H32 (1)
Stoich.:	A4B4C19D32 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-219.55
Dipole, Da:	4.1
IP(EA), eV:	-9.67(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CN1C(=O)C2(CC(CC(C2)(C)C)C)NC1=O

DOS

IR

Vibrations