Geometry & MOs

Info

ID:	437055
PubChem CID:	135214284
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	337.215413
ΔH_f, kcal/mol:	-49.6
Dipole, Da:	3.52
IP(EA), eV:	-8.69(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-1-(2-phenylethyl)-3-(1,2,3,4-tetrahydroisoquinolin-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=C1)C(=O)N(C)CC2CC3=C(CN2)C=C(C=C3)O

DOS

IR

Vibrations