Geometry & MOs

Info

ID:	369943
PubChem CID:	127336844
Reduced:	N3O4C16H31 (1)
Stoich.:	A3B4C16D31 (1)
Weight, g/mol:	271.189592
ΔH_f, kcal/mol:	-203.97
Dipole, Da:	4.52
IP(EA), eV:	-8.98(1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(2-methoxyethyl)pyrrolidin-3-yl]-3-(oxan-3-yl)urea

Drug info:

PubChemData

Smile

CC1(COCCN1CCNC(=O)NCC(C2CCOCC2)O)C

DOS

IR

Vibrations