Geometry & MOs

Info

ID:	354388
PubChem CID:	127286632
Reduced:	OCl2N5C15H21 (1)
Stoich.:	AB2C5D15E21 (1)
Weight, g/mol:	309.241627
ΔH_f, kcal/mol:	-6.98
Dipole, Da:	4.74
IP(EA), eV:	-8.84(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-yl)methyl]-3-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)urea

Drug info:

PubChemData

Smile

C1CC1N2CCN(CC2)C(=O)NCCNC3=C(C=C(C=N3)Cl)Cl

DOS

IR

Vibrations