Geometry & MOs

Info

ID:	358532
PubChem CID:	127296128
Reduced:	O4N5C18H33 (1)
Stoich.:	A4B5C18D33 (1)
Weight, g/mol:	313.236542
ΔH_f, kcal/mol:	-200.99
Dipole, Da:	6.8
IP(EA), eV:	-8.94(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-1-methyl-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)C(=O)CCNC(=O)NCCN2CCOC(C2)(C)C

DOS

IR

Vibrations