Geometry & MOs

Info

ID:	59894
PubChem CID:	24902275
Reduced:	ON2C15H24 (1)
Stoich.:	AB2C15D24 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-52.12
Dipole, Da:	3.32
IP(EA), eV:	-8.82(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 6-carbamoyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C1=CC2=C(CN(CC2)CCCN)C=C1)O

DOS

IR

Vibrations