Geometry & MOs

Info

ID:	347074
PubChem CID:	127271578
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	296.209993
ΔH_f, kcal/mol:	-120.03
Dipole, Da:	7.56
IP(EA), eV:	-9.53(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-1-(oxolan-3-ylmethyl)-3-[1-(oxolan-2-yl)propan-2-yl]urea

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)N2CCNC(=O)C2C3=CC=CC=C3

DOS

IR

Vibrations