Geometry & MOs

Info

ID:	188314
PubChem CID:	77698480
Reduced:	FO3N7C25H26 (1)
Stoich.:	AB3C7D25E26 (1)
Weight, g/mol:	302.21697
ΔH_f, kcal/mol:	-64.93
Dipole, Da:	2.53
IP(EA), eV:	-8.82(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-[3-(difluoromethoxy)-4-methylpent-3-enyl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC(=O)NCC1CN(C(=O)O1)C2(CC(=C(C=C2)C3=CC=CC=C3)F)CN4C=NC5=C(N=CN=C54)NC

DOS

IR

Vibrations