Geometry & MOs

Info

ID:	367308
PubChem CID:	127324087
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	392.188212
ΔH_f, kcal/mol:	-60.93
Dipole, Da:	1.06
IP(EA), eV:	-9.08(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OCCNC(=O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations