Geometry & MOs

Info

ID:	345518
PubChem CID:	127269818
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	312.216141
ΔH_f, kcal/mol:	-94.88
Dipole, Da:	4.19
IP(EA), eV:	-9.43(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-3-(2-oxoazepan-3-yl)urea

Drug info:

PubChemData

Smile

CC1CCN(C1)C(=O)NC2CCN(CC2)C(=O)C3CC3

DOS

IR

Vibrations