Geometry & MOs

Info

ID:	354311
PubChem CID:	127286437
Reduced:	ON6C18H28 (1)
Stoich.:	AB6C18D28 (1)
Weight, g/mol:	363.288577
ΔH_f, kcal/mol:	-0.78
Dipole, Da:	3.67
IP(EA), eV:	-8.57(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-3-[(4-pyrrolidin-1-yloxan-4-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C)N1CCCC(C1)CNC(=O)NC(C)C2=NN=C3N2C=CC=C3

DOS

IR

Vibrations